N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide

C17H23N3O3 — CID 119778208

IUPACN-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
SMILESCOc1ccc(NC(=O)CC2CCCN2)c(C(=O)NC2CC2)c1
InChIInChI=1S/C17H23N3O3/c1-23-13-6-7-15(14(10-13)17(22)19-11-4-5-11)20-16(21)9-12-3-2-8-18-12/h6-7,10-12,18H,2-5,8-9H2,1H3,(H,19,22)(H,20,21)
InChIKeyJWXBYDCQSPYCSB-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.67
Rot. Bonds6

About N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide

N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide (PubChem CID 119778208) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
PubChem CID119778208
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC NameN-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
SMILESCOc1ccc(NC(=O)CC2CCCN2)c(C(=O)NC2CC2)c1
InChIInChI=1S/C17H23N3O3/c1-23-13-6-7-15(14(10-13)17(22)19-11-4-5-11)20-16(21)9-12-3-2-8-18-12/h6-7,10-12,18H,2-5,8-9H2,1H3,(H,19,22)(H,20,21)
InChIKeyJWXBYDCQSPYCSB-UHFFFAOYSA-N
XLogP1.67
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-acetamido-5-methoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119711100
N-(3-methoxyphenyl)-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119680067
N-cyclopropyl-5-methoxy-2-[4-(methylamino)butanoylamino]benzamide;hydrochloride
CID 119778181
2-(4-aminobutanoylamino)-N-cyclopropyl-5-methoxybenzamide
CID 119320449
N-cyclopropyl-5-methoxy-2-(3-piperidin-4-ylbutanoylamino)benzamide;hydrochloride
CID 119778203
N,5-dimethyl-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119800275
5-chloro-N-ethyl-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119770135
N-cyclopropyl-5-methoxy-2-[[2-methyl-3-(methylamino)propanoyl]amino]benzamide
CID 119778200
5-methoxy-2-[(2-thiomorpholin-3-ylacetyl)amino]benzoic acid
CID 115411406
N-methyl-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119693731
N-[2-(4-methoxyphenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 61371395
2-[(3-amino-2-methylbutanoyl)amino]-N-cyclopropyl-5-methoxybenzamide
CID 120500588

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
The IUPAC name of N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide (CID 119778208) is N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide.
What is the SMILES notation for N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
The canonical SMILES for N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide is COc1ccc(NC(=O)CC2CCCN2)c(C(=O)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
The InChIKey is JWXBYDCQSPYCSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-23-13-6-7-15(14(10-13)17(22)19-11-4-5-11)20-16(21)9-12-3-2-8-18-12/h6-7,10-12,18H,2-5,8-9H2,1H3,(H,19,22)(H,20,21).
What are the key properties of N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide?
N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide has a molecular weight of 317.39 g/mol, XLogP of 1.67, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-methoxy-2-[(2-pyrrolidin-2-ylacetyl)amino]benzamide is sourced from PubChem (CID 119778208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).